MDPI-ZINC02149870 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5700 -1.7250 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 -0.7260 1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6460 0.0020 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 0.2940 2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7660 0.9820 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 1.3780 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9290 1.0890 -0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 0.3940 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 0.0030 -0.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -0.2010 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 -1.7510 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5170 -0.0160 3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5360 1.2110 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7960 1.9160 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0480 1.4020 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5750 0.1770 -1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 16 28 1 0 0 0 0 M END